1.161 a 1.170 de 1.297 Resultados
19 nov. 2021 -
Data supporting Mixed-anion mixed-cation perovskite (FAPbI3)0.875(MAPbBr3)0.125: an ab initio molecular dynamics study
Archivo Bzip - 100.0 MB -
MD5: 8969f1746b312c4edbee3af728edc3b3
Position in MD simulation of FAPI(0.875)MAPbr(0.125), times 23ps-31ps. Option COMVEL_TOL to fix de center of mass was activated. |
19 nov. 2021 -
Data supporting Mixed-anion mixed-cation perovskite (FAPbI3)0.875(MAPbBr3)0.125: an ab initio molecular dynamics study
Archivo Bzip - 100.0 MB -
MD5: 27a10d7094f0edd9adbb86d41cb62198
Coordinates of FAPI(0.875)MAPBr(0.125) along the MD simulation. Time interval: 15ps-23ps. |
19 nov. 2021 -
Data supporting Mixed-anion mixed-cation perovskite (FAPbI3)0.875(MAPbBr3)0.125: an ab initio molecular dynamics study
Archivo Bzip - 125.1 MB -
MD5: 5e2cc46ac6182a9a6cd02e3eac0f132b
Coordinates of FAPI(0.875)MAPBr(0.125) along the MD simulation. Time interval: 5 ps-15ps. |
19 nov. 2021 -
Data supporting Mixed-anion mixed-cation perovskite (FAPbI3)0.875(MAPbBr3)0.125: an ab initio molecular dynamics study
Archivo Bzip - 69.5 MB -
MD5: 65ce925a713c9c2b290c31d80893bded
Velocities in MD simulation of FAPI(0.875)MAPBr(0.125), times 23ps-31ps. Option COMVET_TOL to fix de center of mass was activated. |
19 nov. 2021 -
Data supporting Mixed-anion mixed-cation perovskite (FAPbI3)0.875(MAPbBr3)0.125: an ab initio molecular dynamics study
Archivo Bzip - 69.5 MB -
MD5: 1d5e3e56a0fa9827f6a09716a3b8b5d0
Velocities of FAPI(0.875)MAPbr(0.125) in a MD simulation for time interval 15-23 ps. |
19 nov. 2021 -
Data supporting Mixed-anion mixed-cation perovskite (FAPbI3)0.875(MAPbBr3)0.125: an ab initio molecular dynamics study
Archivo Bzip - 86.9 MB -
MD5: c86a784de761b2136505ce79a92e7ea3
Velocities of FAPI(0.875)MAPbr(0.125) in a MD simulation for time interval 5-15 ps. |
19 nov. 2021 -
Data supporting Mixed-anion mixed-cation perovskite (FAPbI3)0.875(MAPbBr3)0.125: an ab initio molecular dynamics study
Archivo Bzip - 132.7 KB -
MD5: c1982e79ee265b33e9edd6278db4137c
Variable cell relaxation of FAPbI3. |
19 nov. 2021 -
Data supporting Mixed-anion mixed-cation perovskite (FAPbI3)0.875(MAPbBr3)0.125: an ab initio molecular dynamics study
Archivo Bzip - 150.2 MB -
MD5: abc0e62e06fbc1b7e61b3f7e6b3d3690
Velocities of molecular dynamics simulation of FAPI. Time interval: 16-28 ps. |
19 nov. 2021 -
Data supporting Mixed-anion mixed-cation perovskite (FAPbI3)0.875(MAPbBr3)0.125: an ab initio molecular dynamics study
Archivo Bzip - 100.1 MB -
MD5: d2d2b3c4de0ad9decced8f04281082a9
Coordinates of molecular dynamics simulation of FAPI. Time interval: 8-16 ps. |
19 nov. 2021 -
Data supporting Mixed-anion mixed-cation perovskite (FAPbI3)0.875(MAPbBr3)0.125: an ab initio molecular dynamics study
Archivo Bzip - 104.0 MB -
MD5: 3aac398fd759f90adcb74d62373a2b0d
Velocities of molecular dynamics simulation of FAPI. Time interval: 16-28 ps. |